N-Benzylacrylamide

C₁₀H₁₁NOCAS 13304-62-6161.20 g/mol

Open in Covalent MOL file

Alkene

Properties

Molecular formula: C₁₀H₁₁NO
Molar mass: 161.20 g/mol
Exact mass: 161.0841 Da
Melting point: 69 °C
Boiling point: 138–140 °C (at 0.3 Torr)
logP: 2.33Crippen estimate
Polar surface area: 32.6 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 3

Hazards

Danger

H302 Harmful if swallowed97.8% of notifiers
H315 Causes skin irritation97.8% of notifiers
H318 Causes serious eye damage86.7% of notifiers
H319 Causes serious eye irritation11.1% of notifiers
H335 May cause respiratory irritation95.6% of notifiers

Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

13304-62-6

SMILES

C=CC(O)=NCc1ccccc1

InChIKey

OHLHOLGYGRKZMU-UHFFFAOYSA-N

InChI

InChI=1S/C10H11NO/c1-2-10(12)11-8-9-6-4-3-5-7-9/h2-7H,1,8H2,(H,11,12)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

4 names

2-Propenamide, N-(phenylmethyl)-
Acrylamide, N-benzyl-
N-(Phenylmethyl)-2-propenamide
N-Benzyl-2-propenamide

Reactions

N-BENZYLACRYLAMIDE (Acrylamide, N-benzyl-)product

Work with N-Benzylacrylamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(2Z)-4-Oxo-4-[(phenylmethyl)amino]-2-butenoic acid15329-69-857 % similar N,N'-Methylenebisacrylamide110-26-950 % similar N-Benzylbenzamide1485-70-750 % similar N-Benzylacetamide588-46-550 % similar N-Benzyl-2-chloroacetamide2564-06-947 % similar N-Methylolacrylamide924-42-547 % similar (2-Hydroxyethyl)acrylamide7646-67-544 % similar N,N′-Bis(acryloyl)cystamine60984-57-843 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

5-Ethoxy-1H-indole10501-17-4 5-Methoxy-2-methylindole1076-74-0 1,2,3,4-Tetrahydro-benzo(b)azepin-5-one1127-74-8 4-Phenyl-2-pyrrolidinone1198-97-6 3-(Methylphenylamino)-2-propenal14189-82-3 1-Acetylindoline16078-30-1 2,5,6-Trimethylbenzoxazole19219-98-8 4-Methoxybenzenepropanenitrile22442-48-4

Elsewhere

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